{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0587563 2.624587 0.4359975 ] [ 0.6130103 1.606213 2.369845 ] [ 2.872214 1.39186 0.7464612 ] [ 1.941337 0.0175427 2.118778 ] [ 2.055015 2.698548 0.547582 ] [ 2.796139 2.772611 2.055467 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.87563e-12 2.624587e-10 4.359975e-11 ] [ 6.130103e-11 1.606213e-10 2.369845e-10 ] [ 2.872214e-10 1.39186e-10 7.464612e-11 ] [ 1.941337e-10 1.75427e-12 2.118778e-10 ] [ 2.055015e-10 2.698548e-10 5.47582e-11 ] [ 2.796139e-10 2.772611e-10 2.055467e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.4450221 -4.7421343 0.8557947 ] [ -9.7914226 6.0131086 9.6597147 ] [ 51.5738512 -127.0003387 -40.692815 ] [ 3.166274 -9.1202353 -0.523445 ] [ -43.5120965 82.6967155 -58.1226959 ] [ 12.008416 52.1528841 88.8234464 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.154130025223361e-08 -7.597736770749946e-09 1.37113427184104e-09 ] [ -1.568758850333953e-08 9.63406209662445e-09 1.547656918344632e-08 ] [ 8.263041931803284e-08 -2.034769751752259e-07 -6.519707736468471e-08 ] [ 5.072930219641716e-09 -1.461222789424198e-08 -8.3865134818413e-10 ] [ -6.971406430865317e-08 1.324947452826456e-07 -9.312282527606758e-08 ] [ 1.923960352655174e-08 8.355813230073012e-08 1.423108503734314e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 42.232643 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.766415380666366e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1604942 2.5263482 0.4479234 ] [ 0.6247967 1.7572466 2.7189496 ] [ 3.1819409 0.6899768 0.1074873 ] [ 1.8627473 -0.2951735 2.0620568 ] [ 2.3055583 3.0124171 0.2286568 ] [ 2.5219226 3.4205465 2.7090568 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.604942e-11 2.5263482e-10 4.479234e-11 ] [ 6.247967e-11 1.7572466e-10 2.7189496e-10 ] [ 3.1819409e-10 6.899768e-11 1.074873e-11 ] [ 1.8627473e-10 -2.951735e-11 2.0620568e-10 ] [ 2.3055583e-10 3.0124171e-10 2.286568e-11 ] [ 2.5219226e-10 3.4205465e-10 2.7090568e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.3e-06 -2.73e-05 -9.7e-06 ] [ 4.8e-06 -4e-06 6.7e-06 ] [ -9.9e-06 3.6e-06 -1.43e-05 ] [ -2.03e-05 -2.21e-05 1.21e-05 ] [ 2.44e-05 3.12e-05 5.3e-06 ] [ 8.2e-06 1.86e-05 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.16958894282e-14 -4.37394221082e-14 -1.55411133498e-14 ] [ 7.690447843199998e-15 -6.408706535999999e-15 1.07345834478e-14 ] [ -1.58615486766e-14 5.767835882399999e-15 -2.29111258662e-14 ] [ -3.252418567019999e-14 -3.54081036114e-14 1.93863372714e-14 ] [ 3.909310986959999e-14 4.998791098079999e-14 8.4915361602e-15 ] [ 1.31378483988e-14 2.98004853924e-14 -3.204353268e-16 ] ] } "relaxed-potential-energy" { "source-value" -17.273917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.767586619505538e-18 } }